[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol

C14H24N2O3 — CID 82960882

IUPAC[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol
SMILESCCOCCN(CCOCC)c1ncccc1CO
InChIInChI=1S/C14H24N2O3/c1-3-18-10-8-16(9-11-19-4-2)14-13(12-17)6-5-7-15-14/h5-7,17H,3-4,8-12H2,1-2H3
InChIKeyBFIMVAATJSEDCE-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.45
Rot. Bonds10

About [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol

[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol (PubChem CID 82960882) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol
PubChem CID82960882
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol
SMILESCCOCCN(CCOCC)c1ncccc1CO
InChIInChI=1S/C14H24N2O3/c1-3-18-10-8-16(9-11-19-4-2)14-13(12-17)6-5-7-15-14/h5-7,17H,3-4,8-12H2,1-2H3
InChIKeyBFIMVAATJSEDCE-UHFFFAOYSA-N
XLogP1.45
TPSA54.82 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-ethoxyethyl(ethyl)amino]pyridine-3-carboxylic acid
CID 63690234
[2-[methyl(propyl)amino]-3-pyridinyl]methanol
CID 61255175
2-[2-ethoxyethyl(ethyl)amino]pyridine-3-carboximidamide
CID 55227687
3-(chloromethyl)-N-ethyl-N-(2-methoxyethyl)pyridin-2-amine
CID 61447035
3-[bis(2-ethoxyethyl)amino]pyrazine-2-carboxylic acid
CID 82960478
4-(aminomethyl)-N,N-bis(2-ethoxyethyl)-3-fluoropyridin-2-amine
CID 105390289
[2-[2-ethoxyethyl(ethyl)amino]-3-fluorophenyl]methanol
CID 114067502
3-[bis(2-ethoxyethyl)amino]pyridine-2-carbothioamide
CID 82965009
[2-[methyl(pentyl)amino]-3-pyridinyl]methanol
CID 61256458
3-[[2-ethoxyethyl(methyl)amino]methyl]pyridin-2-amine
CID 81074924
N-(2-ethoxyethyl)-3-hydroxy-N-methylpyridine-2-carboxamide
CID 81056077
2-[2,2-difluoroethyl-[3-(hydroxymethyl)-2-pyridinyl]amino]ethanol
CID 107484642

Frequently Asked Questions

What is the IUPAC name of [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol?
The IUPAC name of [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol (CID 82960882) is [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol?
The canonical SMILES for [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol is CCOCCN(CCOCC)c1ncccc1CO.
What is the InChIKey of [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol?
The InChIKey is BFIMVAATJSEDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-18-10-8-16(9-11-19-4-2)14-13(12-17)6-5-7-15-14/h5-7,17H,3-4,8-12H2,1-2H3.
What are the key properties of [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol?
[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol has a molecular weight of 268.36 g/mol, XLogP of 1.45, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol is sourced from PubChem (CID 82960882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).